N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-pyridin-3-yl-ethyl]-2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethanamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-pyridin-3-yl-ethyl]-2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethanamide Openeye Name: 2-(4-acetylpiperazin-1-yl)-N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-(3-pyridyl)ethyl]-2-oxo-acetamide CAS Name: 2-(4-acetyl-1-piperazinyl)-N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-(3-pyridinyl)ethyl]-2-oxoacetamide IUPAC Name: 2-(4-acetylpiperazin-1-yl)-N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-pyridin-3-ylethyl]-2-oxoacetamide Traditional Name: 2-(4-acetylpiperazino)-N-[2-(1,3-benzodioxol-5-ylsulfonyl)-2-(3-pyridyl)ethyl]-2-keto-acetamide Formula: C22H24N4O7S MolecularWeight: 488.51356

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C(=O)NCC(C2=CN=CC=C2)S(=O)(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C(=O)NCC(C2=CN=CC=C2)S(=O)(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H24N4O7S/c1-15(27)25-7-9-26(10-8-25)22(29)21(28)24-13-20(16-3-2-6-23-12-16)34(30,31)17-4-5-18-19(11-17)33-14-32-18/h2-6,11-12,20H,7-10,13-14H2,1H3,(H,24,28)